Mol:FL3FEAGS0030

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Copyright: ARM project http://www.metabolome.jp/
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  4  5  2  0  0  0  0
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  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
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  3 18  1  0  0  0  0
 19  1  1  0  0  0  0
  2 20  1  0  0  0  0
 15 21  1  0  0  0  0
 22 23  1  1  0  0  0
 23 24  1  1  0  0  0
 25 24  1  1  0  0  0
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 43 44  2  0  0  0  0
 43 45  1  0  0  0  0
 27 43  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  3  40  41  42
M  SBL   1  1  46
M  SMT   1 ^ COOH
M  SBV   1  46    0.8168   -0.3584
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  3  43  44  45
M  SBL   2  1  49
M  SMT   2 ^ COOH
M  SBV   2  49    0.4306   -0.5251
S  SKP  5
ID	FL3FEAGS0030
FORMULA	C27H26O18
EXACTMASS	638.111914028
AVERAGEMASS	638.4845399999999
SMILES	c(c1)(ccc(C(O2)=CC(c(c(O)5)c2cc(c(O)5)OC(C3OC(O4)C(O)C(C(C4C(O)=O)O)O)OC(C(C3O)O)C(O)=O)=O)c1)O
M  END

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